3-(4-bromanyl-2-methyl-phenoxy)-N-(2-methoxyethyl)propan-1-amine; ethanedioic acid

Systemtic Name: 3-(4-bromanyl-2-methyl-phenoxy)-N-(2-methoxyethyl)propan-1-amine; ethanedioic acid Openeye Name: 3-(4-bromo-2-methyl-phenoxy)-N-(2-methoxyethyl)propan-1-amine; oxalic acid CAS Name: 3-(4-bromo-2-methylphenoxy)-N-(2-methoxyethyl)-1-propanamine; oxalic acid IUPAC Name: 3-(4-bromo-2-methylphenoxy)-N-(2-methoxyethyl)propan-1-amine; oxalic acid Traditional Name: 3-(4-bromo-2-methyl-phenoxy)propyl-(2-methoxyethyl)amine; oxalic acid Formula: C15H22BrNO6 MolecularWeight: 392.24228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCCCNCCOC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCCCNCCOC.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H20BrNO2.C2H2O4/c1-11-10-12(14)4-5-13(11)17-8-3-6-15-7-9-16-2;3-1(4)2(5)6/h4-5,10,15H,3,6-9H2,1-2H3;(H,3,4)(H,5,6)